Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | NAAA | Q02083 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | FDPS | P14324 | 8/20 | 0.38 |
| ▸ | GGPS1 | O95749 | 5/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28922372 | 1.00 | CYP1A2 (0.48) | CYP1A2CNR1NAAASIGMAR1FDPS | |
| SCHEMBL29222459 | 0.84 | CYP1A2 (0.43) | CYP1A2CNR1NAAASIGMAR1FDPS | |
| SCHEMBL28308697 | 0.83 | CYP1A2 (0.39) | CYP1A2SIGMAR1FDPSEPHX1 | |
| SCHEMBL8829753 | 0.82 | CNR1 (0.44) | CYP1A2CNR1NAAASIGMAR1FDPS | |
| SCHEMBL14527696 | 0.82 | CNR1 (0.44) | CYP1A2CNR1NAAASIGMAR1FDPS | |
| SCHEMBL13354356 | 0.82 | CNR1 (0.44) | CYP1A2CNR1NAAASIGMAR1FDPS | |
| SCHEMBL22207321 | 0.82 | CYP1A2 (0.45) | CYP1A2CNR1NAAASIGMAR1FDPS | |
| Methane SCHEMBL28302058 | 0.80 | CYP1A2 (0.43) | CYP1A2CNR1NAAASIGMAR1FDPS | |
| SCHEMBL13859612 | 0.79 | CNR1 (0.47) | CYP1A2CNR1NAAASIGMAR1EPHX1 | |
| SCHEMBL5911505 | 0.79 | CYP1A2 (0.46) | CYP1A2CNR1NAAASIGMAR1EPHX1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1991010679-A2 | RENIN INHIBITING PEPTIDES HAVING AN 'alpha'-HETEROATOM AMINO ACID AT THE P3 POSITION | WARNER LAMBERT CO (US) | 1991-07-25 | — | — | WO | disclosed |